1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine

C9H15N3S — CID 105157139

IUPAC1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
SMILESCCc1nnsc1C(NC)C1CC1
InChIInChI=1S/C9H15N3S/c1-3-7-9(13-12-11-7)8(10-2)6-4-5-6/h6,8,10H,3-5H2,1-2H3
InChIKeyHHQQZVALNRESPK-UHFFFAOYSA-N
MW197.31 g/mol
LogP1.77
Rot. Bonds4

About 1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine

1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine (PubChem CID 105157139) has the molecular formula C9H15N3S and a molecular weight of 197.31 g/mol. Its IUPAC name is 1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
PubChem CID105157139
Molecular FormulaC9H15N3S
Molecular Weight197.31 g/mol
Exact Mass197.10
IUPAC Name1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
SMILESCCc1nnsc1C(NC)C1CC1
InChIInChI=1S/C9H15N3S/c1-3-7-9(13-12-11-7)8(10-2)6-4-5-6/h6,8,10H,3-5H2,1-2H3
InChIKeyHHQQZVALNRESPK-UHFFFAOYSA-N
XLogP1.77
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.31
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclohexyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
CID 105079515
1-(2-ethylcyclohexyl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
CID 105151122
N-[cyclopropyl-(4-propylthiadiazol-5-yl)methyl]ethanamine
CID 105157142
N-[(4-ethylthiadiazol-5-yl)-(oxan-4-yl)methyl]propan-1-amine
CID 105147324
[(4-methylcyclohexyl)-(4-propylthiadiazol-5-yl)methyl]hydrazine
CID 105311794
1-cyclopentyl-N-methyl-1-(4-methylthiadiazol-5-yl)methanamine
CID 105080910
2-cyclopropyl-1-(4-ethylthiadiazol-5-yl)ethanamine
CID 105152733
1-(2-ethylcyclohexyl)-N-methyl-1-(4-propylthiadiazol-5-yl)methanamine
CID 105151094
2-cyclobutyl-1-(4-ethylthiadiazol-5-yl)ethanamine
CID 105151524
(4-ethylthiadiazol-5-yl)-(oxan-4-yl)methanol
CID 105097477
N-[(1R)-1-cyclopropylethyl]-4-ethylthiadiazole-5-carboxamide
CID 30796558
1-(3,5-dimethylphenyl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
CID 105096803

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine?
The IUPAC name of 1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine (CID 105157139) is 1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine is CCc1nnsc1C(NC)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine?
The InChIKey is HHQQZVALNRESPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3S/c1-3-7-9(13-12-11-7)8(10-2)6-4-5-6/h6,8,10H,3-5H2,1-2H3.
What are the key properties of 1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine?
1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine has a molecular weight of 197.31 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine is sourced from PubChem (CID 105157139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).